3-oxidanylidene-3-phenyl-N-prop-2-enyl-2-pyridin-1-ium-1-yl-propanethioamide

Systemtic Name: 3-oxidanylidene-3-phenyl-N-prop-2-enyl-2-pyridin-1-ium-1-yl-propanethioamide Openeye Name: N-allyl-3-oxo-3-phenyl-2-pyridin-1-ium-1-yl-propanethioamide CAS Name: 3-oxo-3-phenyl-N-prop-2-enyl-2-(1-pyridin-1-iumyl)propanethioamide IUPAC Name: 3-oxo-3-phenyl-N-prop-2-enyl-2-pyridin-1-ium-1-ylpropanethioamide Traditional Name: N-allyl-3-keto-3-phenyl-2-pyridin-1-ium-1-yl-thiopropionamide Formula: C17H17N2OS+ MolecularWeight: 297.39468

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Descriptors Computed from Structure

Canonical SMILES:

C=CCNC(=S)C(C(=O)C1=CC=CC=C1)[N+]2=CC=CC=C2

Isomeric SMILES

C=CCNC(=S)C(C(=O)C1=CC=CC=C1)[N+]2=CC=CC=C2

InChI

InChI=1S/C17H16N2OS/c1-2-11-18-17(21)15(19-12-7-4-8-13-19)16(20)14-9-5-3-6-10-14/h2-10,12-13,15H,1,11H2/p+1